1-[6-[2-[(6-azanyl-5-nitro-pyridin-2-yl)amino]ethylamino]-2-pyridin-3-yl-pyridin-3-yl]-4-methyl-piperazin-2-one

Systemtic Name: 1-[6-[2-[(6-azanyl-5-nitro-pyridin-2-yl)amino]ethylamino]-2-pyridin-3-yl-pyridin-3-yl]-4-methyl-piperazin-2-one Openeye Name: 1-[6-[2-[(6-amino-5-nitro-2-pyridyl)amino]ethylamino]-2-(3-pyridyl)-3-pyridyl]-4-methyl-piperazin-2-one CAS Name: 1-[6-[2-[(6-amino-5-nitro-2-pyridinyl)amino]ethylamino]-2-(3-pyridinyl)-3-pyridinyl]-4-methyl-2-piperazinone IUPAC Name: 1-[6-[2-[(6-amino-5-nitropyridin-2-yl)amino]ethylamino]-2-pyridin-3-ylpyridin-3-yl]-4-methylpiperazin-2-one Traditional Name: 1-[6-[2-[(6-amino-5-nitro-2-pyridyl)amino]ethylamino]-2-(3-pyridyl)-3-pyridyl]-4-methyl-piperazin-2-one Formula: C22H25N9O3 MolecularWeight: 463.4924

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(C(=O)C1)C2=C(N=C(C=C2)NCCNC3=NC(=C(C=C3)[N+](=O)[O-])N)C4=CN=CC=C4

Isomeric SMILES

CN1CCN(C(=O)C1)C2=C(N=C(C=C2)NCCNC3=NC(=C(C=C3)[N+](=O)[O-])N)C4=CN=CC=C4

InChI

InChI=1S/C22H25N9O3/c1-29-11-12-30(20(32)14-29)16-4-6-18(27-21(16)15-3-2-8-24-13-15)25-9-10-26-19-7-5-17(31(33)34)22(23)28-19/h2-8,13H,9-12,14H2,1H3,(H,25,27)(H3,23,26,28)